2-butanoyl-1H-indole-3-carboxylic acid

Systemtic Name: 2-butanoyl-1H-indole-3-carboxylic acid Openeye Name: 2-butanoyl-1H-indole-3-carboxylic acid CAS Name: 2-(1-oxobutyl)-1H-indole-3-carboxylic acid IUPAC Name: 2-butanoyl-1H-indole-3-carboxylic acid Traditional Name: 2-butyryl-1H-indole-3-carboxylic acid Formula: C13H13NO3 MolecularWeight: 231.24722

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=C(C2=CC=CC=C2N1)C(=O)O

Isomeric SMILES

CCCC(=O)C1=C(C2=CC=CC=C2N1)C(=O)O

InChI

InChI=1S/C13H13NO3/c1-2-5-10(15)12-11(13(16)17)8-6-3-4-7-9(8)14-12/h3-4,6-7,14H,2,5H2,1H3,(H,16,17)